methyl 3-[4-(cyclopropylamino)quinazolin-2-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[4-(cyclopropylamino)quinazolin-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[4-(cyclopropylamino)quinazolin-2-yl]sulfanylpropanoate CAS Name: 3-[[4-(cyclopropylamino)-2-quinazolinyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(cyclopropylamino)quinazolin-2-yl]sulfanylpropanoate Traditional Name: 3-[[4-(cyclopropylamino)quinazolin-2-yl]thio]propionic acid methyl ester Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=NC2=CC=CC=C2C(=N1)NC3CC3

Isomeric SMILES

COC(=O)CCSC1=NC2=CC=CC=C2C(=N1)NC3CC3

InChI

InChI=1S/C15H17N3O2S/c1-20-13(19)8-9-21-15-17-12-5-3-2-4-11(12)14(18-15)16-10-6-7-10/h2-5,10H,6-9H2,1H3,(H,16,17,18)